3-(hexanoylcarbamothioylamino)-N-methyl-benzamide

Systemtic Name: 3-(hexanoylcarbamothioylamino)-N-methyl-benzamide Openeye Name: 3-(hexanoylcarbamothioylamino)-N-methyl-benzamide CAS Name: N-methyl-3-[[(1-oxohexylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: 3-(hexanoylcarbamothioylamino)-N-methylbenzamide Traditional Name: 3-(caproylthiocarbamoylamino)-N-methyl-benzamide Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NC

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NC

InChI

InChI=1S/C15H21N3O2S/c1-3-4-5-9-13(19)18-15(21)17-12-8-6-7-11(10-12)14(20)16-2/h6-8,10H,3-5,9H2,1-2H3,(H,16,20)(H2,17,18,19,21)